Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | XIAP | P98170 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11872380 | 0.82 | TSHR (0.51) | ALDH1A1TSHRSMN1; SMN2HSD17B10MAPT | |
| SCHEMBL11878613 | 0.79 | TSHR (0.50) | ALDH1A1TSHRLMNASMN1; SMN2TP53 | |
| SCHEMBL11881125 | 0.78 | TSHR (0.64) | ALDH1A1TSHRLMNASMN1; SMN2TP53 | |
| SCHEMBL11873126 | 0.78 | TRPA1 (0.41) | ALDH1A1TSHRLMNACYP1B1HSD17B10 | |
| SCHEMBL11878534 | 0.76 | TSHR (0.56) | ALDH1A1TSHRLMNASMN1; SMN2TP53 | |
| SCHEMBL11877505 | 0.76 | TSHR (0.55) | ALDH1A1TSHRLMNASMN1; SMN2TP53 | |
| SCHEMBL4597225 | 0.71 | CES1 (0.59) | ALDH1A1TSHRSMN1; SMN2TP53CYP1B1 | |
| SCHEMBL11871416 | 0.71 | ALDH1A1 (0.45) | ALDH1A1LMNANPC1RAB9AMAPT | |
| SCHEMBL11880320 | 0.71 | ALDH1A1 (0.41) | ALDH1A1TSHRLMNANPC1RAB9A | |
| SCHEMBL1619449 | 0.69 | ALDH1A1 (0.68) | ALDH1A1TSHRLMNANPC1RAB9A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3978059-A | BRONCHODILATOR AGENTS | SANDOZ, INC. (US) | 1976-08-31 | — | — | US | disclosed |